N-cyclohexyl-N-methyl-2-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]benzamide

Systemtic Name: N-cyclohexyl-N-methyl-2-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: N-cyclohexyl-2-[(4-isopentyloxybenzoyl)carbamothioylamino]-N-methyl-benzamide CAS Name: N-cyclohexyl-N-methyl-2-[[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-cyclohexyl-N-methyl-2-[[4-(3-methylbutoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-cyclohexyl-2-[(4-isoamoxybenzoyl)thiocarbamoylamino]-N-methyl-benzamide Formula: C27H35N3O3S MolecularWeight: 481.6501

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)N(C)C3CCCCC3

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)N(C)C3CCCCC3

InChI

InChI=1S/C27H35N3O3S/c1-19(2)17-18-33-22-15-13-20(14-16-22)25(31)29-27(34)28-24-12-8-7-11-23(24)26(32)30(3)21-9-5-4-6-10-21/h7-8,11-16,19,21H,4-6,9-10,17-18H2,1-3H3,(H2,28,29,31,34)